PDB ligand accession: 9JA
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: MTDIXAKABVYTBV-AUEPDCJTSA-N
SMILES: B1(c2cc(ccc2CNN1S(=O)(=O)CC)Oc3ccc(cc3C=NO)C(F)(F)F)(O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5VRL | Download | Experimental | e5vrlA1 | Rossmann-like | LigPlot |
5W07 | Download | Experimental | e5w07A1 | Rossmann-like | LigPlot |